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3,3'-bis{6",8"-bis(sec-Butyl)-2'',4"-dioxa-7"-thia-6",8"-diazabicyclo[3.3.0]octane} - 7,7-Dioxide
SpectraBase Compound ID 4ebkKJuj7mO
InChI InChI=1S/C22H42N4O8S2/c1-13(2)9-23-17-18(24(10-14(3)4)35(23,27)28)32-21(31-17)22-33-19-20(34-22)26(12-16(7)8)36(29,30)25(19)11-15(5)6/h13-22H,9-12H2,1-8H3
InChIKey XLWBBBOSOBOTLV-UHFFFAOYSA-N
Mol Weight 554.7 g/mol
Molecular Formula C22H42N4O8S2
Exact Mass 554.244407 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LkeS5mxaMdq
Name 3,3'-bis{6",8"-bis(sec-Butyl)-2'',4"-dioxa-7"-thia-6",8"-diazabicyclo[3.3.0]octane} - 7,7-Dioxide
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Formula C22H42N4O8S2
InChI InChI=1S/C22H42N4O8S2/c1-13(2)9-23-17-18(24(10-14(3)4)35(23,27)28)32-21(31-17)22-33-19-20(34-22)26(12-16(7)8)36(29,30)25(19)11-15(5)6/h13-22H,9-12H2,1-8H3
InChIKey XLWBBBOSOBOTLV-UHFFFAOYSA-N
Molecular Weight 554.718 g/mol
SMILES C12N(S(N(C1OC(O2)C1OC2N(CC(C)C)S(N(C2O1)CC(C)C)(=O)=O)CC(C)C)(=O)=O)CC(C)C
SPLASH splash10-0019-0590000000-c88863c006917f3e8101
Source of Spectrum MN-2001-139-2
Wiley ID 1546488